CH 102
3-imino-8,9-dimethoxy-5,6-dihydro-[1,3]thiazolo[4,3-a]isoquinoline-1-carbonitrile
Also Known As: Chinoin 102|CH 102|CH-102|KST-1A7991|KST-1A7992|HE 165|HE-165|(3z)-3-imino-8,9-dimethoxy-5,6-dihydro[1,3]thiazolo[4,3-a]isoquinoline-1-carbonitrile|5,6-Dihydro-3-imino-8,9-dimethoxythiazolo[4,3-a]isoquinoline-1-carbonitrile|3-imino-8,9-dimethoxy-5,6-dihydro-[1,3]thiazolo[4,3-a]isoquinoline-1-carbonitrile|3-imino-8,9-dimethoxy-5,6-dihydro-3H-thiazolo[4,3-a]isoquinoline-1-carbonitrile|8,9-Dimethoxy-3-imino-5,6-dihydro-3H-thiazolo(4,3-a)isoquinoline-1-carbonitrile|1-cyano-3-imino-3,4,5,6-tetrahydro-8,9-dimethoxy-1,3-thiazolo[4,3-a]isoquinoline|1-cyano-3-imino-8,9-dimethoxy-3,4,5,6-tetrahydro-1,3-thiazolo[4,3-a]isoquinoline|3-IMINO-8,9-DIMETHOXY-3H,5H,6H-[1,3]THIAZOLO[4,3-A]ISOQUINOLINE-1-CARBONITRILE|3-Imino-8,9-dimethoxy-5,6-dihydro-3H-[1,3]thiazolo[4,3-a]isoquinoline-1-carbonitrile|3H-Thiazolo(4,3-a)isoquinoline-1-carbonitrile, 5,6-dihydro-3-imino-8,9-dimethoxy-
| Molecular Formula | C14H13N3O2S |
|---|---|
| Molecular Weight | 287.07285 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.07285 |
| Monoisotopic Mass | 287.07285 |
| Heavy Atoms | 20 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 7399-39-5 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)CCN3C2=C(SC3=N)C#N)OC |
| InChIKey | NKOJJXLZHFCSHK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CH 102 (CAS 7399-39-5), with molecular formula C14H13N3O2S and molecular weight 287.07285 g/mol. IUPAC: 3-imino-8,9-dimethoxy-5,6-dihydro-[1,3]thiazolo[4,3-a]isoquinoline-1-carbonitrile.
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